CID 67269927

1508175-90-3

Structural Information

Molecular Formula
C7H13NO
SMILES
CN1CC2C(C1)C2CO
InChI
InChI=1S/C7H13NO/c1-8-2-5-6(3-8)7(5)4-9/h5-7,9H,2-4H2,1H3
InChIKey
NBDARIFQUROSPQ-UHFFFAOYSA-N
Compound name
(3-methyl-3-azabicyclo[3.1.0]hexan-6-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
Patents

127.09972 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 128.10700 129.0
[M+Na]+ 150.08894 139.7
[M-H]- 126.09244 132.0
[M+NH4]+ 145.13354 147.6
[M+K]+ 166.06288 136.3
[M+H-H2O]+ 110.09698 123.7
[M+HCOO]- 172.09792 149.2
[M+CH3COO]- 186.11357 174.2
[M+Na-2H]- 148.07439 133.9
[M]+ 127.09917 130.7
[M]- 127.10027 130.7
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