CID 59289

102280-58-0

Structural Information

Molecular Formula
C15H20N2O
SMILES
CC1=CC2=C(CCCC2)C(=C1C)NC3=NCCO3
InChI
InChI=1S/C15H20N2O/c1-10-9-12-5-3-4-6-13(12)14(11(10)2)17-15-16-7-8-18-15/h9H,3-8H2,1-2H3,(H,16,17)
InChIKey
RIMWFIQWAZTNRF-UHFFFAOYSA-N
Compound name
N-(2,3-dimethyl-5,6,7,8-tetrahydronaphthalen-1-yl)-4,5-dihydro-1,3-oxazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

244.15756 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 245.16484 156.9
[M+Na]+ 267.14678 163.5
[M-H]- 243.15028 163.5
[M+NH4]+ 262.19138 174.5
[M+K]+ 283.12072 160.6
[M+H-H2O]+ 227.15482 149.2
[M+HCOO]- 289.15576 176.3
[M+CH3COO]- 303.17141 168.8
[M+Na-2H]- 265.13223 160.8
[M]+ 244.15701 154.6
[M]- 244.15811 154.6
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