CID 53393300

1341782-83-9

Structural Information

Molecular Formula
C6H13NO
SMILES
CC(C)NC1COC1
InChI
InChI=1S/C6H13NO/c1-5(2)7-6-3-8-4-6/h5-7H,3-4H2,1-2H3
InChIKey
XESAXGZAVQQNBN-UHFFFAOYSA-N
Compound name
N-propan-2-yloxetan-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

110
Patents

115.09972 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 116.10700 123.0
[M+Na]+ 138.08894 127.3
[M-H]- 114.09244 127.0
[M+NH4]+ 133.13354 137.5
[M+K]+ 154.06288 131.9
[M+H-H2O]+ 98.096980 112.6
[M+HCOO]- 160.09792 144.4
[M+CH3COO]- 174.11357 176.2
[M+Na-2H]- 136.07439 129.8
[M]+ 115.09917 130.6
[M]- 115.10027 130.6
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

patents stripe