CID 137935628

2253630-44-1

Structural Information

Molecular Formula
C13H19NO
SMILES
CC1(CC(C1OCC2=CC=CC=C2)N)C
InChI
InChI=1S/C13H19NO/c1-13(2)8-11(14)12(13)15-9-10-6-4-3-5-7-10/h3-7,11-12H,8-9,14H2,1-2H3
InChIKey
HRXWNJURGNORRG-UHFFFAOYSA-N
Compound name
3,3-dimethyl-2-phenylmethoxycyclobutan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

205.14667 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.15395 147.3
[M+Na]+ 228.13589 153.3
[M-H]- 204.13939 153.6
[M+NH4]+ 223.18049 161.6
[M+K]+ 244.10983 153.8
[M+H-H2O]+ 188.14393 136.4
[M+HCOO]- 250.14487 169.3
[M+CH3COO]- 264.16052 192.6
[M+Na-2H]- 226.12134 151.8
[M]+ 205.14612 155.1
[M]- 205.14722 155.1
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

No patent data available for this compound.