CID 545918

N,2,2-trimethylcyclobutan-1-amine hydrochloride

Structural Information

Molecular Formula
C7H15N
SMILES
CC1(CCC1NC)C
InChI
InChI=1S/C7H15N/c1-7(2)5-4-6(7)8-3/h6,8H,4-5H2,1-3H3
InChIKey
PYKVNVUEGYTQOA-UHFFFAOYSA-N
Compound name
N,2,2-trimethylcyclobutan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

113.12045 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 114.12773 124.6
[M+Na]+ 136.10967 130.7
[M-H]- 112.11317 128.6
[M+NH4]+ 131.15427 142.8
[M+K]+ 152.08361 133.2
[M+H-H2O]+ 96.117710 116.0
[M+HCOO]- 158.11865 147.3
[M+CH3COO]- 172.13430 177.2
[M+Na-2H]- 134.09512 131.4
[M]+ 113.11990 131.8
[M]- 113.12100 131.8
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

patents stripe