CID 83478743

1539197-30-2

Structural Information

Molecular Formula
C7H15NO
SMILES
CC(C)C1(COC1)CN
InChI
InChI=1S/C7H15NO/c1-6(2)7(3-8)4-9-5-7/h6H,3-5,8H2,1-2H3
InChIKey
YSFSJQZZESOLCN-UHFFFAOYSA-N
Compound name
(3-propan-2-yloxetan-3-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

129.11537 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.12265 129.6
[M+Na]+ 152.10459 134.3
[M-H]- 128.10809 133.3
[M+NH4]+ 147.14919 145.2
[M+K]+ 168.07853 138.4
[M+H-H2O]+ 112.11263 120.3
[M+HCOO]- 174.11357 150.0
[M+CH3COO]- 188.12922 178.1
[M+Na-2H]- 150.09004 135.7
[M]+ 129.11482 136.8
[M]- 129.11592 136.8
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