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]+ 255.20671 163.5
[M+Na]+ 277.18865 169.4
[M-H]- 253.19215 168.4
[M+NH4]+ 272.23325 174.4
[M+K]+ 293.16259 166.3
[M+H-H2O]+ 237.19669 156.5
[M+HCOO]- 299.19763 179.9
[M+CH3COO]- 313.21328 200.2
[M+Na-2H]- 275.17410 164.3
[M]+ 254.19888 162.8
[M]- 254.19998 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.