CID 155904567

Tert-butyl (3r,4r)-4-(aminomethyl)-3-cyclopropylpiperidine-1-carboxylate

Structural Information

Molecular Formula
C14H26N2O2
SMILES
CC(C)(C)OC(=O)N1CC[C@H]([C@H](C1)C2CC2)CN
InChI
InChI=1S/C14H26N2O2/c1-14(2,3)18-13(17)16-7-6-11(8-15)12(9-16)10-4-5-10/h10-12H,4-9,15H2,1-3H3/t11-,12+/m0/s1
InChIKey
OPPBYPZAECRLDS-NWDGAFQWSA-N
Compound name
tert-butyl (3R,4R)-4-(aminomethyl)-3-cyclopropylpiperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

254.19943 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 255.206706 163.5
[M+Na]+ 277.188648 169.4
[M-H]- 253.192154 168.4
[M+NH4]+ 272.233253 174.4
[M+K]+ 293.162588 166.3
[M+H-H2O]+ 237.196690 156.5
[M+HCOO]- 299.197631 179.9
[M+CH3COO]- 313.213281 200.2
[M+Na-2H]- 275.174096 164.3
[M]+ 254.19888142 162.8
[M]- 254.19997858 162.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.