CID 66724375

Tert-butyl n-(2-aminocyclobutyl)carbamate

Structural Information

Molecular Formula
C9H18N2O2
SMILES
CC(C)(C)OC(=O)NC1CCC1N
InChI
InChI=1S/C9H18N2O2/c1-9(2,3)13-8(12)11-7-5-4-6(7)10/h6-7H,4-5,10H2,1-3H3,(H,11,12)
InChIKey
QEVWCEYVNCWPKJ-UHFFFAOYSA-N
Compound name
tert-butyl N-(2-aminocyclobutyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

44
Patents

186.13683 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 187.14411 146.6
[M+Na]+ 209.12605 150.1
[M-H]- 185.12955 149.4
[M+NH4]+ 204.17065 159.1
[M+K]+ 225.09999 153.2
[M+H-H2O]+ 169.13409 135.3
[M+HCOO]- 231.13503 166.8
[M+CH3COO]- 245.15068 189.9
[M+Na-2H]- 207.11150 149.3
[M]+ 186.13628 153.0
[M]- 186.13738 153.0
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