CID 84729350

1779790-33-8

Structural Information

Molecular Formula
C14H28N2O2
SMILES
CC(C)(C)OC(=O)NCC(C1CCCCCC1)N
InChI
InChI=1S/C14H28N2O2/c1-14(2,3)18-13(17)16-10-12(15)11-8-6-4-5-7-9-11/h11-12H,4-10,15H2,1-3H3,(H,16,17)
InChIKey
DLWPQUYKDPNMHK-UHFFFAOYSA-N
Compound name
tert-butyl N-(2-amino-2-cycloheptylethyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

256.2151 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.22238 159.3
[M+Na]+ 279.20432 158.6
[M-H]- 255.20782 162.0
[M+NH4]+ 274.24892 174.0
[M+K]+ 295.17826 162.9
[M+H-H2O]+ 239.21236 153.1
[M+HCOO]- 301.21330 175.9
[M+CH3COO]- 315.22895 200.7
[M+Na-2H]- 277.18977 159.9
[M]+ 256.21455 151.6
[M]- 256.21565 151.6
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.