CID 21061045

363192-67-0

Structural Information

Molecular Formula
C15H25NO4
SMILES
CC(C)(C)OC(=O)N1CCC(CC1)(CC2CC2)C(=O)O
InChI
InChI=1S/C15H25NO4/c1-14(2,3)20-13(19)16-8-6-15(7-9-16,12(17)18)10-11-4-5-11/h11H,4-10H2,1-3H3,(H,17,18)
InChIKey
YATOYPVKSCZYBJ-UHFFFAOYSA-N
Compound name
4-(cyclopropylmethyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-4-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

30
Patents

283.17834 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 284.185616 169.5
[M+Na]+ 306.167558 175.0
[M-H]- 282.171064 173.3
[M+NH4]+ 301.212163 180.5
[M+K]+ 322.141498 173.3
[M+H-H2O]+ 266.175600 164.0
[M+HCOO]- 328.176541 182.9
[M+CH3COO]- 342.192191 199.0
[M+Na-2H]- 304.153006 170.9
[M]+ 283.17779142 170.7
[M]- 283.17888858 170.7
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

patents stripe